[4-(4-methylphenyl)phenyl] 5-bromanyl-1-benzofuran-2-carboxylate

Systemtic Name: [4-(4-methylphenyl)phenyl] 5-bromanyl-1-benzofuran-2-carboxylate Openeye Name: [4-(p-tolyl)phenyl] 5-bromobenzofuran-2-carboxylate CAS Name: 5-bromo-2-benzofurancarboxylic acid [4-(4-methylphenyl)phenyl] ester IUPAC Name: [4-(4-methylphenyl)phenyl] 5-bromo-1-benzofuran-2-carboxylate Traditional Name: 5-bromocoumarilic acid [4-(p-tolyl)phenyl] ester Formula: C22H15BrO3 MolecularWeight: 407.2567

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC4=C(O3)C=CC(=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC4=C(O3)C=CC(=C4)Br

InChI

InChI=1S/C22H15BrO3/c1-14-2-4-15(5-3-14)16-6-9-19(10-7-16)25-22(24)21-13-17-12-18(23)8-11-20(17)26-21/h2-13H,1H3